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1-tert-butyl 2-methyl (2R,4R)-4-aminopiperidine-1,2-dicarboxylate

1-tert-butyl 2-methyl (2R,4R)-4-aminopiperidine-1,2-dicarboxylate

CAS: 778646-95-0

Formula: C12H22N2O4

SMILES: COC(=O)[C@H]1C[C@H](N)CCN1C(=O)OC(C)(C)C

IUPAC: 1-tert-butyl 2-methyl (2R,4R)-4-aminopiperidine-1,2-dicarboxylate

InChI: InChI=1S/C12H22N2O4/c1-12(2,3)18-11(16)14-6-5-8(13)7-9(14)10(15)17-4/h8-9H,5-7,13H2,1-4H3/t8-,9-/m1/s1

Composition: C (55.80%), H (8.58%), N (10.84%), O (24.77%)

Molar Mass: 258.318

Atom Count: 40

Heavy Atom Count: 18

Properties
Properties
Common Names N/A
Aromatic Ring Count 0
Asymmetric Atom Count 2
Exact Mass 258.157957196
Formal Charge 0
FSP3 0.83
Hetero Ring Count 1
Hydrogen Bond Acceptor Count 3
Hydrogen Bond Donor Count 1
InChIKey PVCVXOYIRODFJD-RKDXNWHRSA-N
Lipinski's Rule of Five 1
Molar Refractivity 65.67
Topological Polar Surface Area 81.86
Polarizability 26.35
Ring Count 1
Rotatable Bond Count 4

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Purity LeadTime CAS PacketSize UnitPrice
97% <5 Days 778646-95-0 $252.20-$353.08$252.20$353.08
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